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Density functional theory studies on direct and oxygen assisted activation of C–H bond for dry reforming of methane over Rh–Ni catalyst

Lei Tang, Xin Huang, Jingyu Ran, Fan Guo, Juntian Niu, Huayu Qiu, Zhiliang Ou, Yunfei Yan, Zhongqing Yang, Changlei Qin

2022International Journal of Hydrogen Energy23 citationsDOI

Topics & Concepts

CatalysisDissociation (chemistry)Density functional theoryChemistrySyngasMethaneCarbon dioxide reformingOxygenAdsorptionActivation energyBond-dissociation energyPhysical chemistryComputational chemistryOrganic chemistryCatalytic Processes in Materials ScienceCatalysts for Methane ReformingCatalysis and Oxidation Reactions
Density functional theory studies on direct and oxygen assisted activation of C–H bond for dry reforming of methane over Rh–Ni catalyst | Litcius